N-(4-chloranyl-3-nitro-phenyl)-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(4-chloranyl-3-nitro-phenyl)-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-(4-chloro-3-nitro-phenyl)-2-[4-[(3-methylisoxazol-5-yl)methyl]piperazin-1-yl]acetamide CAS Name: N-(4-chloro-3-nitrophenyl)-2-[4-[(3-methyl-5-isoxazolyl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-(4-chloro-3-nitrophenyl)-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]acetamide Traditional Name: N-(4-chloro-3-nitro-phenyl)-2-[4-[(3-methylisoxazol-5-yl)methyl]piperazino]acetamide Formula: C17H20ClN5O4 MolecularWeight: 393.8248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CN2CCN(CC2)CC(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=NOC(=C1)CN2CCN(CC2)CC(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H20ClN5O4/c1-12-8-14(27-20-12)10-21-4-6-22(7-5-21)11-17(24)19-13-2-3-15(18)16(9-13)23(25)26/h2-3,8-9H,4-7,10-11H2,1H3,(H,19,24)